Coherent excitation of molecules with laser pulses are usually described by coupled time-
dependent linear parabolic partial differential equations, ie, Schr6dinger equations …

The first unified treatment of experimental and theoreticaladvances in low-temperature
chemistry Chemical Dynamics at LowTemperatures is a landmark publication. For the first …

The idea of using a good representation as the zeroth order description of a problem, which
is widely used in perturbation theory and in basis set calculations, is extended to the path …

This article discusses the use of path integral techniques for the study of dynamical
processes in many-body quantum systems. Recently developed approaches are described …

Equilibrium and dynamical Fourier path integral methods Page 69 EQUILIBRIUM AND
DYNAMICAL FOURIER PATH INTEGRAL METHODS JD DOLL Department of Chemistry …

A stochastic technique for highly nonlocal actions has been developed and applied to the
Fröhlich Hamiltonian describing an optical polaron. The energy and the effective mass of the …

The ''good''action variables associated with a transition state (ie, the saddle point of a
potential energy surface), on which a general semiclassical transition state theory is based …

We extend recent flux− flux autocorrelation function methods for the direct computation of
thermal reaction rate constants and unimolecular recombination rates to the case where …

We first show that a simple scaling of fluctuation coordinates defined in terms of a given
reference point gives the conventional virial estimator in discretized path integral, where …

The optimal control theory approach to designing optimal fields for bond-selective
unimolecular reactions is presented. A set of equations for determining the optimal fields …